==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 15-APR-10 2XBT . COMPND 2 MOLECULE: CELLULOSOMAL SCAFFOLDIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES CELLULOSOLVENS; . AUTHOR O.YANIV,L.J.W.SHIMON,E.A.BAYER,R.LAMED,F.FROLOW . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7830.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 96 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 38.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 15 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 1 1 0 2 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 3 A P 0 0 138 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-160.5 23.4 17.5 -12.1 2 4 A V - 0 0 119 1,-0.0 2,-0.7 151,-0.0 150,-0.3 -0.667 360.0-134.3 -81.6 132.2 22.1 17.0 -8.6 3 5 A Q - 0 0 101 -2,-0.4 150,-0.2 150,-0.1 2,-0.1 -0.779 19.1-142.2 -87.9 113.7 24.5 17.5 -5.8 4 6 A V - 0 0 63 148,-2.2 147,-0.0 -2,-0.7 -1,-0.0 -0.434 30.9 -93.5 -73.8 150.4 24.2 14.7 -3.3 5 7 A N + 0 0 160 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 -0.308 61.5 138.6 -63.4 145.8 24.6 15.6 0.4 6 8 A S - 0 0 32 147,-0.1 26,-0.0 2,-0.1 -3,-0.0 -0.932 59.2-116.7-168.0 174.3 28.0 15.3 1.9 7 9 A D S S+ 0 0 59 -2,-0.3 26,-3.1 2,-0.0 2,-0.3 0.009 73.3 125.5-108.0 25.7 30.1 17.3 4.3 8 10 A L E +A 32 0A 12 24,-0.2 2,-0.4 145,-0.1 24,-0.2 -0.679 34.1 178.4 -91.5 137.4 32.8 17.8 1.6 9 11 A K E -A 31 0A 97 22,-2.2 22,-3.2 -2,-0.3 2,-0.5 -0.999 16.3-145.1-139.4 139.2 34.0 21.3 0.6 10 12 A L E -A 30 0A 1 -2,-0.4 131,-0.4 20,-0.2 2,-0.4 -0.911 8.0-168.1-109.8 129.1 36.6 22.4 -1.9 11 13 A L E -A 29 0A 33 18,-2.7 18,-2.0 -2,-0.5 2,-0.4 -0.870 16.8-166.2-105.1 146.9 38.9 25.4 -1.5 12 14 A F E +AB 28 139A 0 127,-3.0 127,-2.7 -2,-0.4 2,-0.3 -0.984 17.9 163.1-138.1 142.2 40.8 26.5 -4.6 13 15 A S E -A 27 0A 4 14,-2.4 14,-2.8 -2,-0.4 123,-0.2 -0.975 19.9-165.1-148.2 163.6 43.7 28.7 -5.5 14 16 A N > - 0 0 1 121,-2.7 3,-1.5 -2,-0.3 122,-0.2 0.065 58.9 -95.9-135.4 24.5 46.0 29.1 -8.5 15 17 A N T 3 S- 0 0 99 120,-0.8 121,-0.3 121,-0.3 119,-0.1 0.797 77.7 -65.8 66.1 27.7 48.8 31.2 -7.1 16 18 A G T 3 S- 0 0 23 119,-1.3 -1,-0.3 1,-0.2 120,-0.2 0.603 81.4-177.7 68.8 12.9 47.1 34.3 -8.5 17 19 A A < - 0 0 11 -3,-1.5 -1,-0.2 118,-0.3 118,-0.1 -0.062 17.8-133.0 -45.5 137.4 47.7 33.1 -12.1 18 20 A A - 0 0 52 2,-0.4 107,-0.2 116,-0.1 -1,-0.1 -0.410 28.6 -97.8 -86.5 168.8 46.5 35.5 -14.8 19 21 A A S S+ 0 0 38 -2,-0.1 106,-3.1 1,-0.1 2,-0.7 0.895 119.4 58.2 -53.1 -41.7 44.4 34.5 -17.8 20 22 A S E S+E 124 0B 97 104,-0.2 -2,-0.4 105,-0.1 2,-0.3 -0.842 79.8 149.9 -92.7 117.5 47.6 34.4 -19.8 21 23 A S E -E 123 0B 15 102,-2.0 102,-2.9 -2,-0.7 3,-0.1 -0.971 57.0-125.2-147.7 154.6 49.9 31.9 -18.1 22 24 A N S S- 0 0 85 -2,-0.3 95,-0.4 100,-0.2 2,-0.3 0.717 96.5 -3.3 -73.5 -20.9 52.7 29.4 -18.9 23 25 A Q S S- 0 0 23 93,-0.1 2,-0.5 100,-0.1 93,-0.2 -0.976 81.2 -92.3-160.4 164.9 50.7 26.6 -17.3 24 26 A I E - C 0 115A 5 91,-3.3 91,-2.3 -2,-0.3 2,-0.5 -0.781 37.3-152.8 -86.4 129.0 47.5 25.9 -15.4 25 27 A Y E + C 0 114A 45 -2,-0.5 2,-0.4 89,-0.2 89,-0.2 -0.890 14.8 179.1-102.9 132.3 47.9 26.1 -11.6 26 28 A M E + C 0 113A 0 87,-2.5 87,-2.7 -2,-0.5 2,-0.5 -0.909 5.7 169.9-133.3 105.0 45.5 24.0 -9.4 27 29 A N E +AC 13 112A 10 -14,-2.8 -14,-2.4 -2,-0.4 2,-0.4 -0.969 17.5 177.0-116.3 121.1 46.0 24.2 -5.6 28 30 A M E -AC 12 111A 1 83,-3.6 83,-3.4 -2,-0.5 2,-0.5 -0.939 26.3-165.4-131.8 143.3 43.1 22.5 -3.8 29 31 A K E -AC 11 110A 56 -18,-2.0 -18,-2.7 -2,-0.4 2,-0.6 -0.983 11.9-162.0-123.2 118.5 42.1 21.7 -0.3 30 32 A L E -AC 10 109A 0 79,-2.5 79,-2.1 -2,-0.5 2,-0.3 -0.897 16.6-167.1 -99.7 121.3 39.3 19.2 0.1 31 33 A Q E -AC 9 108A 47 -22,-3.2 -22,-2.2 -2,-0.6 2,-0.6 -0.817 21.2-148.4-111.5 148.3 37.8 19.5 3.6 32 34 A N E -A 8 0A 3 75,-2.6 -24,-0.2 -2,-0.3 65,-0.0 -0.973 15.1-179.0-110.6 117.4 35.4 17.2 5.5 33 35 A T + 0 0 85 -26,-3.1 -25,-0.1 -2,-0.6 2,-0.1 0.465 58.5 58.8 -95.0 -4.1 33.3 19.5 7.8 34 36 A G S S- 0 0 16 -27,-0.3 65,-2.5 2,-0.1 -2,-0.1 -0.307 92.7 -91.6-117.0-162.9 31.3 16.7 9.4 35 37 A S S S+ 0 0 106 63,-0.2 63,-0.2 -2,-0.1 2,-0.1 0.479 88.0 92.8 -99.3 -4.4 31.5 13.5 11.4 36 38 A S - 0 0 57 61,-0.1 2,-0.4 1,-0.0 63,-0.2 -0.279 69.2-129.2 -74.1 169.9 31.7 10.9 8.6 37 39 A T - 0 0 94 61,-0.1 2,-0.4 60,-0.1 60,-0.2 -0.944 18.0-152.7-119.7 148.3 34.9 9.6 7.1 38 40 A Y E -F 96 0C 27 58,-2.6 58,-3.4 -2,-0.4 2,-0.6 -0.971 13.9-129.5-125.1 138.0 35.6 9.5 3.3 39 41 A D E > -F 95 0C 53 -2,-0.4 3,-2.2 56,-0.2 56,-0.2 -0.747 12.9-151.6 -86.0 115.8 37.8 7.2 1.3 40 42 A L G > S+ 0 0 0 54,-2.2 3,-1.8 -2,-0.6 51,-0.5 0.758 91.1 70.8 -61.9 -24.3 40.1 9.3 -0.9 41 43 A S G 3 S+ 0 0 57 53,-0.6 -1,-0.3 1,-0.3 54,-0.1 0.662 97.2 53.5 -66.8 -12.8 40.3 6.5 -3.5 42 44 A K G < S+ 0 0 75 -3,-2.2 107,-2.7 48,-0.1 108,-0.5 0.376 89.8 98.3-100.9 2.9 36.7 7.3 -4.3 43 45 A I E < +G 148 0D 2 -3,-1.8 48,-1.4 105,-0.2 2,-0.3 -0.761 45.6 177.8 -94.2 134.3 37.2 11.0 -4.9 44 46 A T E -GH 147 90D 12 103,-1.9 103,-2.8 -2,-0.4 2,-0.4 -0.975 10.3-159.7-127.3 150.2 37.6 12.5 -8.4 45 47 A I E -GH 146 89D 3 44,-2.1 44,-2.9 -2,-0.3 2,-0.5 -0.988 4.5-157.8-126.9 136.8 38.1 16.1 -9.3 46 48 A R E -GH 145 88D 61 99,-2.8 99,-2.0 -2,-0.4 2,-0.5 -0.973 8.0-171.0-121.6 131.5 37.4 17.6 -12.7 47 49 A Y E - H 0 87D 3 40,-2.0 40,-2.9 -2,-0.5 2,-0.3 -0.985 21.9-146.0-116.4 119.1 38.8 20.9 -14.0 48 50 A F E + H 0 86D 2 -2,-0.5 82,-2.5 95,-0.5 83,-0.3 -0.699 28.3 155.4 -98.0 139.1 37.1 21.8 -17.3 49 51 A Y E - H 0 85D 12 36,-2.2 36,-2.2 -2,-0.3 35,-1.6 -0.921 39.5-106.4-154.4 173.3 39.0 23.6 -20.1 50 52 A T - 0 0 43 33,-0.3 2,-0.9 -2,-0.3 77,-0.1 -0.930 28.2-135.1-116.2 128.0 39.1 24.3 -23.8 51 53 A S - 0 0 10 -2,-0.5 32,-0.0 1,-0.2 -2,-0.0 -0.762 3.6-150.1 -90.5 107.6 41.7 22.7 -25.9 52 54 A D S S- 0 0 73 -2,-0.9 -1,-0.2 1,-0.2 71,-0.0 0.856 84.2 -34.0 -21.3 -60.8 43.4 25.0 -28.3 53 55 A D S S- 0 0 94 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.0 -0.009 95.3 -76.5-176.0 34.5 44.0 22.3 -30.8 54 56 A D + 0 0 114 1,-0.2 2,-0.2 2,-0.0 3,-0.0 0.826 68.9 169.2 60.2 35.3 44.6 18.9 -29.1 55 57 A K - 0 0 69 1,-0.1 2,-0.2 62,-0.0 -1,-0.2 -0.532 45.9 -93.1 -71.0 147.7 48.2 19.7 -28.1 56 58 A A - 0 0 78 -2,-0.2 62,-0.8 1,-0.0 2,-0.3 -0.441 44.9-161.7 -68.7 128.5 49.7 17.2 -25.7 57 59 A L E -D 117 0A 32 -2,-0.2 2,-0.4 60,-0.2 60,-0.2 -0.795 5.8-155.0-110.2 153.3 49.3 18.1 -22.0 58 60 A T E -D 116 0A 54 58,-2.6 58,-1.9 -2,-0.3 2,-0.5 -0.991 8.9-143.1-127.6 134.8 51.1 16.9 -18.9 59 61 A Y E -D 115 0A 30 -2,-0.4 2,-0.6 56,-0.2 56,-0.2 -0.857 13.1-158.1 -96.7 129.8 49.9 16.9 -15.3 60 62 A Y E -D 114 0A 96 54,-3.1 54,-1.7 -2,-0.5 2,-1.1 -0.935 5.2-153.7-109.9 114.5 52.5 17.6 -12.7 61 63 A S E +D 113 0A 58 -2,-0.6 52,-0.2 52,-0.2 3,-0.1 -0.749 24.1 166.0 -89.2 98.5 51.7 16.4 -9.2 62 64 A D E + 0 0 79 50,-1.5 2,-0.3 -2,-1.1 -1,-0.2 0.903 63.6 0.3 -79.5 -46.8 53.8 18.7 -7.0 63 65 A Y E +D 112 0A 113 49,-1.8 49,-3.2 5,-0.0 2,-0.4 -0.970 50.2 173.8-151.6 130.7 52.2 18.0 -3.6 64 66 A V E -D 111 0A 22 -2,-0.3 47,-0.2 47,-0.2 3,-0.1 -0.944 18.3-156.5-136.4 116.6 49.5 15.8 -2.2 65 67 A S S S+ 0 0 31 45,-2.4 2,-0.4 -2,-0.4 46,-0.1 0.722 83.1 32.3 -70.6 -23.6 49.2 15.8 1.6 66 68 A I S S- 0 0 23 44,-0.3 27,-0.2 28,-0.1 -1,-0.2 -0.983 124.1 -36.5-135.3 125.7 47.6 12.4 1.8 67 69 A G S S- 0 0 43 -2,-0.4 2,-0.3 25,-0.1 -3,-0.2 -0.418 89.4 -65.6 67.8-134.9 48.3 9.5 -0.6 68 70 A S - 0 0 64 25,-0.2 24,-2.4 -2,-0.1 25,-0.4 -0.965 35.1-138.4-151.5 163.0 48.9 10.5 -4.2 69 71 A A E -I 91 0D 15 -2,-0.3 2,-0.3 22,-0.2 22,-0.2 -0.941 14.0-178.4-127.9 147.6 47.2 11.9 -7.2 70 72 A S E -I 90 0D 73 20,-1.9 20,-2.7 -2,-0.3 2,-0.3 -0.939 12.9-148.1-139.3 163.9 47.2 11.1 -10.9 71 73 A A E -I 89 0D 28 -2,-0.3 2,-0.3 18,-0.2 18,-0.2 -0.959 11.2-168.4-139.1 149.8 45.4 12.7 -13.9 72 74 A T E -I 88 0D 67 16,-1.7 16,-2.6 -2,-0.3 2,-0.4 -0.937 20.9-133.2-128.4 156.1 43.9 12.0 -17.2 73 75 A F E -I 87 0D 66 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.950 33.2-179.8-113.6 135.0 42.7 14.3 -20.0 74 76 A N E -I 86 0D 43 12,-2.3 12,-2.1 -2,-0.4 2,-0.3 -0.938 31.8-105.9-140.1 148.1 39.3 13.6 -21.4 75 77 A N E -I 85 0D 116 -2,-0.3 2,-0.4 10,-0.2 10,-0.3 -0.558 35.6-137.0 -72.8 137.4 36.8 14.8 -24.0 76 78 A L E - 0 0 22 8,-2.1 3,-0.1 -2,-0.3 4,-0.1 -0.811 19.8-134.0 -95.4 135.9 33.8 16.6 -22.5 77 79 A S E S+ 0 0 105 -2,-0.4 2,-0.1 1,-0.3 7,-0.0 -0.973 85.2 25.2-145.4 133.6 30.3 15.9 -23.8 78 80 A P E S- 0 0 116 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 0.551 100.4-122.5 -78.7 160.6 28.2 17.6 -24.5 79 81 A V E - 0 0 101 -2,-0.1 2,-0.3 -3,-0.1 5,-0.2 -0.198 21.6-147.7 -65.7 153.1 30.6 20.5 -25.3 80 82 A H E > -I 83 0D 58 3,-2.8 3,-1.6 1,-0.1 49,-0.1 -0.869 28.4-110.7-120.4 155.9 30.3 23.9 -23.5 81 83 A A T 3 S+ 0 0 97 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.822 122.6 32.6 -52.2 -32.3 31.0 27.4 -24.8 82 84 A K T 3 S+ 0 0 83 1,-0.2 47,-2.3 46,-0.1 2,-0.3 0.210 121.6 43.5-113.9 15.7 34.0 27.3 -22.4 83 85 A A E < + I 0 80D 0 -3,-1.6 -3,-2.8 45,-0.2 -33,-0.3 -0.861 29.6 159.8-164.6 126.9 35.0 23.7 -22.3 84 86 A N E S+ 0 0 47 -35,-1.6 -8,-2.1 -2,-0.3 2,-0.3 0.295 81.0 31.5-119.6 2.9 35.6 20.8 -24.7 85 87 A K E -HI 49 75D 22 -36,-2.2 -36,-2.2 -10,-0.3 2,-0.3 -0.925 61.7-154.3-144.7 168.5 37.8 18.8 -22.3 86 88 A Y E -HI 48 74D 28 -12,-2.1 -12,-2.3 -2,-0.3 2,-0.5 -0.985 16.0-134.7-145.8 146.6 38.4 18.1 -18.6 87 89 A I E -HI 47 73D 1 -40,-2.9 -40,-2.0 -2,-0.3 2,-0.5 -0.851 23.5-155.1 -86.5 135.1 41.3 17.0 -16.5 88 90 A E E -HI 46 72D 25 -16,-2.6 -16,-1.7 -2,-0.5 2,-0.5 -0.965 5.2-162.6-115.1 119.0 40.2 14.3 -14.1 89 91 A I E -HI 45 71D 2 -44,-2.9 -44,-2.1 -2,-0.5 2,-0.4 -0.846 5.6-166.8-100.6 128.6 42.3 14.0 -10.9 90 92 A K E -HI 44 70D 100 -20,-2.7 -20,-1.9 -2,-0.5 2,-0.3 -0.951 12.9-142.7-118.0 135.2 42.0 10.8 -9.0 91 93 A L E - 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